Vitas-M small molecule compound
7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-[4-(1H-pyrazol-1-yl)phenyl]-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione
Catalog ID
STL550059
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(cc1)n1cccn1)c(=O)n(c(=O)n3C)C)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C32H28ClN5O7 MW 630.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28ClN5O7/c1-15-13-18-22(27(39)32(15)28(40)23-19(43-4)14-20(44-5)25(33)26(23)45-32)21(16-7-9-17(10-8-16)38-12-6-11-34-38)24-29(35-18)36(2)31(42)37(3)30(24)41/h6-12,14-15,21,39H,13H2,1-5H3InChIKey
OPLREDMFAMKSSS-UHFFFAOYSA-NSynonyms
7chloro6hydroxy46dimethoxy138trimethyl5(4(1Hpyrazol1yl)phenyl)1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC32H28ClN5O7c115131822(27(39)32(15)28(40)2319(434)1420(445)25(33)26(23)4532)21(167917(10816)38126113438)2429(3518)36(2)31(42)37(3)30(24)41h61214152139H13H215H3
MFCD31757368
ZINC000888089570
ZINC000888089573
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